2-[2-chloranyl-6-[(3-methyl-1-phenoxy-butan-2-yl)amino]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol

Systemtic Name: 2-[2-chloranyl-6-[(3-methyl-1-phenoxy-butan-2-yl)amino]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol Openeye Name: 2-[2-chloro-6-[[2-methyl-1-(phenoxymethyl)propyl]amino]purin-9-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol CAS Name: 2-[2-chloro-6-[(3-methyl-1-phenoxybutan-2-yl)amino]-9-purinyl]-5-(hydroxymethyl)oxolane-3,4-diol IUPAC Name: 2-[2-chloro-6-[(3-methyl-1-phenoxybutan-2-yl)amino]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol Traditional Name: 2-[2-chloro-6-[[2-methyl-1-(phenoxymethyl)propyl]amino]purin-9-yl]-5-methylol-tetrahydrofuran-3,4-diol Formula: C21H26ClN5O5 MolecularWeight: 463.91464

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(COC1=CC=CC=C1)NC2=NC(=NC3=C2N=CN3C4C(C(C(O4)CO)O)O)Cl

Isomeric SMILES

CC(C)C(COC1=CC=CC=C1)NC2=NC(=NC3=C2N=CN3C4C(C(C(O4)CO)O)O)Cl

InChI

InChI=1S/C21H26ClN5O5/c1-11(2)13(9-31-12-6-4-3-5-7-12)24-18-15-19(26-21(22)25-18)27(10-23-15)20-17(30)16(29)14(8-28)32-20/h3-7,10-11,13-14,16-17,20,28-30H,8-9H2,1-2H3,(H,24,25,26)